Ligand

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Ligand Name:   PHENYLALANINE
HET ID:   PHE PubChem:   6140, 6925665
DrugBank:   DB00120 ChEMBL:   CHEMBL301523
Canonical SMILES:   N[C@H](C(=O)O)Cc1ccccc1
Standard InChI:   InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1
Molecular Formula:   C9H11NO2 Mol. Weight:   165.18913 Heavy Atoms:   12
Charge:   0 Is Chiral:   True logP:   1.3413
HBD:   2 HBA:   3 TPSA:   63.32
#Bonds:   13 #Rotatable Bonds:   3 Shape Complexity:   0.22222222
Stereocomplexity:   0.11111111
Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID Binding Affinity Binding Database Complex Card
Leucine-specific-binding protein P04816 (LIVK_ECOLI) Escherichia coli 1USI
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